3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole

C15H14N2S3 — CID 22473909

IUPAC3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole
SMILESCSC1=C(c2cc(C)c3sccc3c2)N2CCN=C2S1
InChIInChI=1S/C15H14N2S3/c1-9-7-11(8-10-3-6-19-13(9)10)12-14(18-2)20-15-16-4-5-17(12)15/h3,6-8H,4-5H2,1-2H3
InChIKeyIRNHSHQAMYTJGR-UHFFFAOYSA-N
MW318.49 g/mol
LogP4.62
Rot. Bonds2

About 3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole

3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole (PubChem CID 22473909) has the molecular formula C15H14N2S3 and a molecular weight of 318.49 g/mol. Its IUPAC name is 3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole
PubChem CID22473909
Molecular FormulaC15H14N2S3
Molecular Weight318.49 g/mol
Exact Mass318.03
IUPAC Name3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole
SMILESCSC1=C(c2cc(C)c3sccc3c2)N2CCN=C2S1
InChIInChI=1S/C15H14N2S3/c1-9-7-11(8-10-3-6-19-13(9)10)12-14(18-2)20-15-16-4-5-17(12)15/h3,6-8H,4-5H2,1-2H3
InChIKeyIRNHSHQAMYTJGR-UHFFFAOYSA-N
XLogP4.62
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.49
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole (CID 22473909) is 3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole is CSC1=C(c2cc(C)c3sccc3c2)N2CCN=C2S1.
What is the InChIKey of 3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The InChIKey is IRNHSHQAMYTJGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2S3/c1-9-7-11(8-10-3-6-19-13(9)10)12-14(18-2)20-15-16-4-5-17(12)15/h3,6-8H,4-5H2,1-2H3.
What are the key properties of 3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole has a molecular weight of 318.49 g/mol, XLogP of 4.62, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-methyl-1-benzothiophen-5-yl)-2-methylsulfanyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 22473909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).